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84890-07-3 | Benzene, hexakis(phenylseleno)-
CAS No: 84890-07-3 Catalog No: AG004M92 MDL No:
Product Description
Catalog Number:
AG004M92
Chemical Name:
Benzene, hexakis(phenylseleno)-
CAS Number:
84890-07-3
Molecular Formula:
C42H30Se6
Molecular Weight:
1008.4476
IUPAC Name:
1,2,3,4,5,6-hexakis(phenylselanyl)benzene
InChI:
InChI=1S/C42H30Se6/c1-7-19-31(20-8-1)43-37-38(44-32-21-9-2-10-22-32)40(46-34-25-13-4-14-26-34)42(48-36-29-17-6-18-30-36)41(47-35-27-15-5-16-28-35)39(37)45-33-23-11-3-12-24-33/h1-30H
InChI Key:
QCPTUPVZNZWHLP-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)[Se]c1c([Se]c2ccccc2)c([Se]c2ccccc2)c(c(c1[Se]c1ccccc1)[Se]c1ccccc1)[Se]c1ccccc1
Properties
Complexity:
680
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1009.735g/mol
Formal Charge:
0
Heavy Atom Count:
48
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
1008.528g/mol
Monoisotopic Mass:
1013.734g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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